You can:
Name | CHEMBL49630 |
---|---|
Molecular formula | C20H23N5O3S |
IUPAC name | 1,1-dioxo-2-[[(1S,2S)-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]cyclopropyl]methyl]-1,2-benzothiazol-3-one |
Molecular weight | 413.496 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 0 |
XlogP | 1.5 |
Synonyms | BDBM50280297 1,1-Dioxo-2-[(1S,2S)-2-(4-pyrimidin-2-yl-piperazin-1-ylmethyl)-cyclopropylmethyl]-1,2-dihydro-1lambda*6*-benzo[d]isothiazol-3-one |
Inchi Key | KNTNKMFODKUWSB-HZPDHXFCSA-N |
Inchi ID | InChI=1S/C20H23N5O3S/c26-19-17-4-1-2-5-18(17)29(27,28)25(19)14-16-12-15(16)13-23-8-10-24(11-9-23)20-21-6-3-7-22-20/h1-7,15-16H,8-14H2/t15-,16-/m1/s1 |
PubChem CID | 44292289 |
ChEMBL | CHEMBL49630 |
IUPHAR | N/A |
BindingDB | 50280297 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
173682 | 5-hydroxytryptamine receptor 1A | Q64264 | Htr1a | Mus musculus (Mouse) | 421 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218